furan-2-ylmethyl-(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium chloride

Systemtic Name: furan-2-ylmethyl-(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium chloride Openeye Name: 2-furylmethyl-(2-phenylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium chloride CAS Name: 2-furanylmethyl-(2-phenyl-4-benzofuro[3,2-d]pyrimidinyl)ammonium chloride IUPAC Name: furan-2-ylmethyl-(2-phenyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)azanium chloride Traditional Name: 2-furfuryl-(2-phenylbenzofuro[3,2-d]pyrimidin-4-yl)ammonium chloride Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C(=N2)[NH2+]CC4=CC=CO4)OC5=CC=CC=C53.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C(=N2)[NH2+]CC4=CC=CO4)OC5=CC=CC=C53.[Cl-]

InChI

InChI=1S/C21H15N3O2.ClH/c1-2-7-14(8-3-1)20-23-18-16-10-4-5-11-17(16)26-19(18)21(24-20)22-13-15-9-6-12-25-15;/h1-12H,13H2,(H,22,23,24);1H